Chemical Properties of 2,6-BIS(t-BUTYL)-4-(DIMETHYLBENZYL)PHENOL

InChI

InChI=1S/C23H32O/c1-21(2,3)18-14-17(15-19(20(18)24)22(4,5)6)23(7,8)16-12-10-9-11-13-16/h9-15,24H,1-8H3

InChI Key

ROEHFIIRMUXFRR-UHFFFAOYSA-N

Formula

C23H32O

SMILES

CC(C)(C)c1cc(C(C)(C)c2ccccc2)cc(C(C)(C)C)c1O

Molecular Weight¹

324.51

Other Names

• 2,6-Bis(t-butyl)-4-(dimethylbenzyl)phenol
• 2,6-bis(tert-butyl)-4-(1-methyl-1-phenylethyl)phenol
• 2,6-Di-tert-butyl-4-(2-phenylpropan-2-yl)phenol

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.7224		Relay (1.0) Calculated Property
ΔfH°gas	-227.12	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	26.17	kJ/mol	Joback Calculated Property
ΔvapH°	108.36	kJ/mol	Relay (1.0) Calculated Property
IE	7.70	eV	Relay (1.0) Calculated Property
log10WS	-6.55		Relay (1.0) Calculated Property
logPoct/wat	6.313		Crippen Calculated Property
McVol	293.280	ml/mol	McGowan Calculated Property
Pc	1493.04	kPa	Joback Calculated Property
Inp	[2083.20; 2083.20]
Inp	2083.20		NIST
Inp	2083.20		NIST
Tboil	598.64	K	Relay (1.0) Calculated Property
Tc	905.92	K	Relay (1.0) Calculated Property
Tfus	385.73	K	Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[926.37; 1034.17]	J/mol×K	[859.89; 1105.09]
Cp,gas	926.37	J/mol×K	859.89	Joback Calculated Property
Cp,gas	945.78	J/mol×K	900.76	Joback Calculated Property
Cp,gas	964.27	J/mol×K	941.62	Joback Calculated Property
Cp,gas	982.11	J/mol×K	982.49	Joback Calculated Property
Cp,gas	999.54	J/mol×K	1023.36	Joback Calculated Property
Cp,gas	1016.81	J/mol×K	1064.23	Joback Calculated Property
Cp,gas	1034.17	J/mol×K	1105.09	Joback Calculated Property
η	[0.0000016; 0.0000732]	Pa×s	[545.83; 859.89]
η	0.0000732	Pa×s	545.83	Joback Calculated Property
η	0.0000295	Pa×s	598.17	Joback Calculated Property
η	0.0000137	Pa×s	650.52	Joback Calculated Property
η	0.0000072	Pa×s	702.86	Joback Calculated Property
η	0.0000041	Pa×s	755.20	Joback Calculated Property
η	0.0000025	Pa×s	807.55	Joback Calculated Property
η	0.0000016	Pa×s	859.89	Joback Calculated Property

Similar Compounds

Find more compounds similar to 2,6-BIS(t-BUTYL)-4-(DIMETHYLBENZYL)PHENOL.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.